dimethyl-[(2S)-1-oxidanyl-2-phenyl-butan-2-yl]azanium

Systemtic Name: dimethyl-[(2S)-1-oxidanyl-2-phenyl-butan-2-yl]azanium Openeye Name: [(1S)-1-(hydroxymethyl)-1-phenyl-propyl]-dimethyl-ammonium CAS Name: [(2S)-1-hydroxy-2-phenylbutan-2-yl]-dimethylammonium IUPAC Name: [(2S)-1-hydroxy-2-phenylbutan-2-yl]-dimethylazanium Traditional Name: dimethyl-[(1S)-1-methylol-1-phenyl-propyl]ammonium Formula: C12H20NO+ MolecularWeight: 194.2933

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(C1=CC=CC=C1)[NH+](C)C

Isomeric SMILES

CC[C@@](CO)(C1=CC=CC=C1)[NH+](C)C

InChI

InChI=1S/C12H19NO/c1-4-12(10-14,13(2)3)11-8-6-5-7-9-11/h5-9,14H,4,10H2,1-3H3/p+1/t12-/m1/s1